methyl 1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(2-methylpropyl)-4-methylsulfonyl-piperazine-2-carboxylate

Systemtic Name: methyl 1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(2-methylpropyl)-4-methylsulfonyl-piperazine-2-carboxylate Openeye Name: methyl 1-(4-tert-butyl-3-methoxy-benzoyl)-2-isobutyl-4-methylsulfonyl-piperazine-2-carboxylate CAS Name: 1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-2-(2-methylpropyl)-4-methylsulfonyl-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-tert-butyl-3-methoxybenzoyl)-2-(2-methylpropyl)-4-methylsulfonylpiperazine-2-carboxylate Traditional Name: 1-(4-tert-butyl-3-methoxy-benzoyl)-2-isobutyl-4-mesyl-piperazine-2-carboxylic acid methyl ester Formula: C23H36N2O6S MolecularWeight: 468.60674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CN(CCN1C(=O)C2=CC(=C(C=C2)C(C)(C)C)OC)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC(C)CC1(CN(CCN1C(=O)C2=CC(=C(C=C2)C(C)(C)C)OC)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C23H36N2O6S/c1-16(2)14-23(21(27)31-7)15-24(32(8,28)29)11-12-25(23)20(26)17-9-10-18(22(3,4)5)19(13-17)30-6/h9-10,13,16H,11-12,14-15H2,1-8H3